SCHEMBL3291371

SCHEMBL3291371

CC(C)(C)OC(=O)NCCCNCc1c2ccccc2cc2ccccc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4A O75164 1/20 0.47
▸ NQO2 P16083 1/20 0.46
▸ MAOA P21397 1/20 0.44
▸ MAOB P27338 1/20 0.44
▸ CYP3A4 P08684 1/20 0.43
▸ ABCB1 P08183 1/20 0.43
▸ IDO1 P14902 1/20 0.43
▸ ACACB O00763 1/20 0.43
▸ ACACA Q13085 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ CA1 P00915 1/20 0.42
▸ CA2 P00918 1/20 0.42
▸ CNR2 P34972 1/20 0.42
▸ BRD4 O60885 1/20 0.41
▸ BCHE P06276 1/20 0.41
▸ STK17B O94768 1/20 0.41
▸ STK17A Q9UEE5 1/20 0.41
▸ DRD2 P14416 1/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ GAA P10253 1/20 0.41

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL15586616 0.93 KDM4A (0.49) KDM4ANQO2CYP3A4ABCB1IDO1
SCHEMBL3293311 0.89 CA14 (0.46) KDM4ANQO2MAOAMAOBCYP3A4
SCHEMBL3244389 0.87 MAOA (0.55) MAOAMAOBCYP3A4TDP1CA1
SCHEMBL976700 0.87 MAOA (0.55) MAOAMAOBCYP3A4TDP1CA1
SCHEMBL28759617 0.81 NQO2 (0.54) KDM4ANQO2MAOAMAOBCYP3A4
SCHEMBL14208425 0.81 SLC2A1 (0.54) NQO2MEN1GAAKMT2A
SCHEMBL23228318 0.80 NQO2 (0.47) KDM4ANQO2CYP3A4IDO1TDP1
SCHEMBL30442477 0.80 MAOA (0.44) MAOAMAOBCYP3A4TDP1CA1
SCHEMBL975698 0.80 MAOA (0.44) MAOAMAOBCYP3A4TDP1CA1
SCHEMBL6559442 0.79 ATM (0.55) MAOAMAOBCYP3A4IDO1TDP1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7728041-B2 Motuporamine mimic agents UNIVERSITY OF CENTRAL FLORIDA RESEARCH FOUNDATION, INC. (US) 2010-06-01 — — US disclosed
US-20090069441-A1 Motuporamine Mimic Agents UNIVERSITY OF CENTRAL FLORIDA RESEARCH FOUNDATION, INC. 2009-03-12 — — US disclosed
US-20070213397-A1 Motuporamine mimic agents UNIVERSITY OF CENTRAL FLORIDA RESEARCH FOUNDATION, INC. 2007-09-13 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070213397-A1 Motuporamine mimic agents MYADM, CD99, HNMT KDM4A 2427/4885NQO2 3347/4885MAOA 742/4885
US-20090069441-A1 Motuporamine Mimic Agents MYADM, CD99, HNMT KDM4A 2427/4885NQO2 3347/4885MAOA 742/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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